2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide

C15H14BrNO3 — CID 64793819

IUPAC2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide
SMILESCOc1ccc(Br)c(C(=O)Nc2cccc(O)c2C)c1
InChIInChI=1S/C15H14BrNO3/c1-9-13(4-3-5-14(9)18)17-15(19)11-8-10(20-2)6-7-12(11)16/h3-8,18H,1-2H3,(H,17,19)
InChIKeyHPLSUVKWNXUWIA-UHFFFAOYSA-N
MW336.19 g/mol
LogP3.72
Rot. Bonds3

About 2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide

2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide (PubChem CID 64793819) has the molecular formula C15H14BrNO3 and a molecular weight of 336.19 g/mol. Its IUPAC name is 2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide.

Molecular Properties

Compound Name2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide
PubChem CID64793819
Molecular FormulaC15H14BrNO3
Molecular Weight336.19 g/mol
Exact Mass335.02
IUPAC Name2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide
SMILESCOc1ccc(Br)c(C(=O)Nc2cccc(O)c2C)c1
InChIInChI=1S/C15H14BrNO3/c1-9-13(4-3-5-14(9)18)17-15(19)11-8-10(20-2)6-7-12(11)16/h3-8,18H,1-2H3,(H,17,19)
InChIKeyHPLSUVKWNXUWIA-UHFFFAOYSA-N
XLogP3.72
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.19
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-5-methoxy-N-(2-methyl-3-nitrophenyl)benzamide
CID 18190907
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CID 103479738
2-bromo-5-methoxy-N-[2-(methylcarbamoyl)phenyl]benzamide
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2-bromo-N-(3-hydroxyphenyl)-5-methoxybenzamide
CID 28739934
2-bromo-N-(5-bromo-4-fluoro-2-methylphenyl)-5-methoxybenzamide
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5-methoxy-2-methyl-N-(2-methyl-3-sulfamoylphenyl)benzamide
CID 126612439
2-bromo-5-methoxy-N-[2-(methylaminomethyl)phenyl]benzamide
CID 43600896
2-bromo-N-(2-cyano-3-fluorophenyl)-5-methoxybenzamide
CID 43580467
2-bromo-N-(2,6-dichlorophenyl)-5-methoxybenzamide
CID 60629817
2-bromo-N-(6-bromo-2-methyl-3-pyridinyl)-5-methoxybenzamide
CID 103909645
2-bromo-N-(5-fluoro-2-methylphenyl)-5-methoxybenzamide
CID 2446537
2-bromo-N'-(2-hydroxybenzoyl)-5-methoxybenzohydrazide
CID 7661752

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide?
The IUPAC name of 2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide (CID 64793819) is 2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide.
What is the SMILES notation for 2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide?
The canonical SMILES for 2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide is COc1ccc(Br)c(C(=O)Nc2cccc(O)c2C)c1.
What is the InChIKey of 2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide?
The InChIKey is HPLSUVKWNXUWIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrNO3/c1-9-13(4-3-5-14(9)18)17-15(19)11-8-10(20-2)6-7-12(11)16/h3-8,18H,1-2H3,(H,17,19).
What are the key properties of 2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide?
2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide has a molecular weight of 336.19 g/mol, XLogP of 3.72, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(3-hydroxy-2-methylphenyl)-5-methoxybenzamide is sourced from PubChem (CID 64793819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).